(3S,4R,5S)-3-(3-Chloro-2-Fluorophenyl)-4-(4-Chloro-2-Fluorophenyl)-4-Cyano-N-[(3S)-3,4-Dihydroxybutyl]-5-(2,2-Dimethylpropyl)-D-Prolinamide
Properties
| Property | Value |
|---|---|
| Formula | C27H31Cl2F2N3O3 |
| IUPAC Name | (2r,3s,4r,5s)-3-(3-chloro-2-fluoro-phenyl)-4-(4-chloro-2-fluoro-phenyl)-4-cyano-n-[(3s)-3,4-dihydroxybutyl]-5-(2,2-dimethylpropyl)pyrrolidine-2-carboxamide |
| Molecular Mass | 554.456 g·mol−1 |
| Heat of Formation | -836.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.44 ± 1.08 D |
| Volume | 638.81 Å 3 |
| Surface Area | 498.06 Å 2 |
| HOMO Energy | -9.81 ± 0.55 eV |
| LUMO Energy | 2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MSOWFEGZEMCNQZ-UIHIWPSYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H F O N |